1-(4-butan-2-ylphenyl)-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea Openeye Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-[(1-ethyl-5-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-(4-sec-butylphenyl)thiourea Formula: C18H26N4S MolecularWeight: 330.49084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NCC2=C(N(N=C2)CC)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NCC2=C(N(N=C2)CC)C

InChI

InChI=1S/C18H26N4S/c1-5-13(3)15-7-9-17(10-8-15)21-18(23)19-11-16-12-20-22(6-2)14(16)4/h7-10,12-13H,5-6,11H2,1-4H3,(H2,19,21,23)